SCHEMBL20094255

SCHEMBL20094255

Cc1cc(C(=O)O)cc(O)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.52
▸ CA1 P00915 4/20 0.52
▸ CA2 P00918 4/20 0.52
▸ CA7 P43166 4/20 0.52
▸ CA9 Q16790 4/20 0.52
▸ CA14 Q9ULX7 4/20 0.52
▸ CA4 P22748 3/20 0.52
▸ CA6 P23280 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ MAPT P10636 2/20 0.52
▸ CA3 P07451 2/20 0.52
▸ CA5A P35218 2/20 0.52
▸ CA5B Q9Y2D0 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ SELL P14151 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ SELP P16109 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7827636 0.87 TPMT (0.54) CA12CA1CA2CA7CA9
SCHEMBL2183846 0.81 CES2 (0.48) CA12CA1CA2CA7CA9
SCHEMBL27668741 0.79 TPMT (0.46) CA12CA1CA2CA7CA9
SCHEMBL25981011 0.79 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL31210112 0.78 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL3353646 0.78 CA12 (0.70) CA12CA1CA2CA7CA9
SCHEMBL13199302 0.78 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL26690845 0.78 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL21836981 0.78 TTR (0.52) CA12CA1CA2CA7CA9
SCHEMBL16994423 0.78 TTR (0.52) CA12CA1CA2CA7CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4223751-A1 BENZAMIDE COMPOUND AND USE THEREOF Humanwell Healthcare (Group) Co., Ltd. (CN) 2023-08-09 — — EP disclosed
WO-2018072707-A1 AROMATIC ETHER DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICAL APPLICATIONS THEREOF 保诺科技(北京)有限公司 2018-04-26 — — WO disclosed
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